Compound Detail
CHEMBL5596908
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Cn1cc(-c2cc3c(Oc4ccc(NC(=O)C5(C(=O)Nc6ccc(F)cc6)CC5)cc4)ncnn3c2)cn1
Basic Information
| ChEMBL ID | CHEMBL5596908 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MNUPLQVJAOMLAS-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
511.5
MW (Da)
4.42
ALogP
8
HBA
2
HBD
115.4
PSA (Ų)
0.31
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.58
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor UFO CHEMBL4895 | IC50 | 7.58 | 7.58 | 26.0 | 1 |
| Hepatocyte growth factor receptor CHEMBL3717 | IC50 | 7.5 | 7.5 | 32.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor UFO | IC50 | = | 26.0 | nM | 7.58 | Inhibition of AXL (unknown origin) | 38733884 |
| Hepatocyte growth factor receptor | IC50 | = | 32.0 | nM | 7.5 | Inhibition of c-MET (unknown origin) | 38733884 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38733884 | 10.1016/j.ejmech.2024.116477 | Hepatocyte growth factor receptor | 1 |
| 38733884 | 10.1016/j.ejmech.2024.116477 | Tyrosine-protein kinase receptor UFO | 1 |
Data from ChEMBL 36 via Core Engine